(4-nitrophenyl)methyl 2-(acetamidooxymethyl)-4-(triphenylmethyl)sulfanyl-pyrrolidine-1-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 2-(acetamidooxymethyl)-4-(triphenylmethyl)sulfanyl-pyrrolidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl 2-(acetamidooxymethyl)-4-tritylsulfanyl-pyrrolidine-1-carboxylate CAS Name: 2-(acetamidooxymethyl)-4-[(triphenylmethyl)thio]-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-(acetamidooxymethyl)-4-tritylsulfanylpyrrolidine-1-carboxylate Traditional Name: 2-(acetamidooxymethyl)-4-(tritylthio)pyrrolidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C34H33N3O6S MolecularWeight: 611.70732

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NOCC1CC(CN1C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])SC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC(=O)NOCC1CC(CN1C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])SC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C34H33N3O6S/c1-25(38)35-43-24-31-21-32(22-36(31)33(39)42-23-26-17-19-30(20-18-26)37(40)41)44-34(27-11-5-2-6-12-27,28-13-7-3-8-14-28)29-15-9-4-10-16-29/h2-20,31-32H,21-24H2,1H3,(H,35,38)